N-(4-iodophenyl)-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(4-iodophenyl)-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(4-iodophenyl)-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(4-iodophenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(4-iodophenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(4-iodophenyl)-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C16H12IN3O2S MolecularWeight: 437.25485

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)I)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)I)NC1=S

InChI

InChI=1S/C16H12IN3O2S/c1-20-15(22)12-7-2-9(8-13(12)19-16(20)23)14(21)18-11-5-3-10(17)4-6-11/h2-8H,1H3,(H,18,21)(H,19,23)